Molecule ID: mol1404

SMILES: C1CN2CCC1CC2

InChI: InChI=1S/C7H13N/c1-4-8-5-2-7(1)3-6-8/h7H,1-6H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.95 Organic Oxygen Acids and Nitrogen Bases 1 » 0
10.95 OCHEM 1 » 0
10.95 OCHEM 1 » 0
10.95 Hunt 1 » 0
11.04 Datawarrior 1 » 0
11.04 OCHEM 1 » 0
11.04 AttenGpKa training set 1 » 0
11.49 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization